5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole

C17H12N4O2 — CID 146420394

IUPAC5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole
SMILESCOc1cc(-c2nc(-c3ccc4ccccc4n3)no2)ccn1
InChIInChI=1S/C17H12N4O2/c1-22-15-10-12(8-9-18-15)17-20-16(21-23-17)14-7-6-11-4-2-3-5-13(11)19-14/h2-10H,1H3
InChIKeyKYEBZSQEZSMKMY-UHFFFAOYSA-N
MW304.31 g/mol
LogP3.36
Rot. Bonds3

About 5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole

5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole (PubChem CID 146420394) has the molecular formula C17H12N4O2 and a molecular weight of 304.31 g/mol. Its IUPAC name is 5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole
PubChem CID146420394
Molecular FormulaC17H12N4O2
Molecular Weight304.31 g/mol
Exact Mass304.10
IUPAC Name5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole
SMILESCOc1cc(-c2nc(-c3ccc4ccccc4n3)no2)ccn1
InChIInChI=1S/C17H12N4O2/c1-22-15-10-12(8-9-18-15)17-20-16(21-23-17)14-7-6-11-4-2-3-5-13(11)19-14/h2-10H,1H3
InChIKeyKYEBZSQEZSMKMY-UHFFFAOYSA-N
XLogP3.36
TPSA73.93 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole with MolForge

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Related Compounds

3-(2-methoxy-4-pyridinyl)-5-pyridin-3-yl-1,2,4-oxadiazole
CID 95907164
3-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-5-(2-methoxy-4-pyridinyl)-1,2,4-oxadiazole
CID 155951530
3-(2-methoxy-4-pyridinyl)-5-(1,2,5-thiadiazol-3-yl)-1,2,4-oxadiazole
CID 100611843
5-(3-ethoxy-2-pyridinyl)-3-(2-methoxy-4-pyridinyl)-1,2,4-oxadiazole
CID 75483087
3-(2-methoxy-4-pyridinyl)-5-[(1R)-1-pyridin-2-ylsulfanylethyl]-1,2,4-oxadiazole
CID 97089615
3-(2-methoxyquinolin-3-yl)-5-pyridin-3-yl-1,2,4-oxadiazole
CID 665532
4-[3-(6-methoxypyrimidin-4-yl)-1,2,4-oxadiazol-5-yl]benzene-1,2-diol
CID 136904552
1-amino-1-(3-quinolin-2-yl-1,2,4-oxadiazol-5-yl)propan-2-ol
CID 63218930
2-[3-(2-methoxy-4-pyridinyl)phenyl]-4-phenylpyrimidine
CID 134837723
5-(3,5-dimethoxyphenyl)-3-(2-ethoxyquinolin-3-yl)-1,2,4-oxadiazole
CID 4552356
4-quinolin-2-ylpyridin-2-amine
CID 82556017
4-[3-(6-methoxypyrimidin-4-yl)-1,2,4-oxadiazol-5-yl]-2-methylaniline
CID 102949476

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole?
The IUPAC name of 5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole (CID 146420394) is 5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole.
What is the SMILES notation for 5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole?
The canonical SMILES for 5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole is COc1cc(-c2nc(-c3ccc4ccccc4n3)no2)ccn1.
What is the InChIKey of 5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole?
The InChIKey is KYEBZSQEZSMKMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N4O2/c1-22-15-10-12(8-9-18-15)17-20-16(21-23-17)14-7-6-11-4-2-3-5-13(11)19-14/h2-10H,1H3.
What are the key properties of 5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole?
5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole has a molecular weight of 304.31 g/mol, XLogP of 3.36, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxy-4-pyridinyl)-3-quinolin-2-yl-1,2,4-oxadiazole is sourced from PubChem (CID 146420394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).